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CHEBI:232231 - 7-oxohistidinolithocholic acid
| Formula | C30H45N3O5 |
| Net Charge | 0 |
| Average Mass | 527.706 |
| Monoisotopic Mass | 527.33592 |
| SMILES | C[C@H](CCC(=O)N[C@@H](Cc1cncn1)C(=O)O)[C@H]1CC[C@H]2[C@@H]3C(=O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |
| InChI | InChI=1S/C30H45N3O5/c1-17(4-7-26(36)33-24(28(37)38)14-19-15-31-16-32-19)21-5-6-22-27-23(9-11-30(21,22)3)29(2)10-8-20(34)12-18(29)13-25(27)35/h15-18,20-24,27,34H,4-14H2,1-3H3,(H,31,32)(H,33,36)(H,37,38)/t17-,18+,20-,21-,22+,23+,24+,27+,29+,30-/m1/s1 |
| InChIKey | ILMBBZQTLJGZFL-LFWCUWLYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 7-oxohistidinolithocholic acid (CHEBI:232231) is a organic molecular entity (CHEBI:50860) |